SCHEMBL9120331

SCHEMBL9120331

CCCc1c(O)ccc2c1OCCC2=O

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ LTB4R Q15722 12/20 0.56
▸ LTB4R2 Q9NPC1 12/20 0.56
▸ MAOA P21397 1/20 0.42
▸ MAOB P27338 1/20 0.42
▸ PSMB5 P28074 1/20 0.41
▸ ESR1 P03372 1/20 0.39
▸ ESR2 Q92731 1/20 0.39
▸ HSD17B1 P14061 1/20 0.37
▸ PTPN1 P18031 1/20 0.35
▸ CYP1A1 P04798 1/20 0.35
▸ CYP1B1 Q16678 1/20 0.35
▸ GRM5 P41594 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL30251527 1.00 LTB4R (0.56) LTB4RLTB4R2MAOAMAOBPSMB5
SCHEMBL9121287 0.90 LTB4R (0.50) LTB4RLTB4R2MAOAMAOBESR1
SCHEMBL23882856 0.88 LTB4R (0.46) LTB4RLTB4R2MAOAMAOBPSMB5
SCHEMBL6561553 0.85 PSMB5 (0.58) LTB4RLTB4R2PSMB5ESR1ESR2
SCHEMBL8463571 0.80 MAOB (0.49) LTB4RLTB4R2MAOAMAOBGRM5
SCHEMBL9119318 0.77 GRM5 (0.44) LTB4RLTB4R2MAOAMAOBPSMB5
SCHEMBL30251104 0.76 ESR1 (0.51) LTB4RLTB4R2MAOAMAOBPSMB5
SCHEMBL12316602 0.76 ESR1 (0.51) LTB4RLTB4R2MAOAMAOBPSMB5
SCHEMBL20554846 0.73 MAOB (0.47) LTB4RLTB4R2MAOAMAOBPSMB5
SCHEMBL20554446 0.73 MAOB (0.47) LTB4RLTB4R2MAOAMAOBPSMB5

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4126835-B1 INHIBITORS OF ANTIGEN PRESENTATION BY HLA-DR JANSSEN PHARMACEUTICA NV (BE) 2026-02-18 — — EP disclosed
US-12516038-B2 Inhibitors of antigen presentation by HLA-DR JANSSEN PHARMACEUTICA NV (BE) 2026-01-06 — — US disclosed
US-20230150985-A1 INHIBITORS OF ANTIGEN PRESENTATION BY HLA-DR JANSSEN PHARMACEUTICA NV (BE) 2023-05-18 — — US disclosed
EP-4126835-A1 INHIBITORS OF ANTIGEN PRESENTATION BY HLA-DR Janssen Pharmaceutica NV (BE) 2023-02-08 — — EP disclosed
WO-2021198283-A1 INHIBITORS OF ANTIGEN PRESENTATION BY HLA-DR JANSSEN PHARMACEUTICA NV (BE) 2021-10-07 — — WO disclosed
US-5434186-A Antiinflammatory agents HOFFMANN-LA ROCHE INC. (US) 1995-07-18 — — US disclosed
US-5273999-A A 4-keto-boroalkyleneoxychroman or 2,3-dihydrobenzofuran derivative HOFFMANN-LA ROCHE INC. (US) 1993-12-28 — — US disclosed
EP-0531823-A1 Bicyclic carboxylic acid derivatives as anti-inflammatory agents F. HOFFMANN-LA ROCHE AG (CH) 1993-03-17 — — EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230150985-A1 INHIBITORS OF ANTIGEN PRESENTATION BY HLA-DR HLA-DRB1, CD74, HLA-C LTB4R 562/4885LTB4R2 644/4885MAOA 1864/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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